5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide

C89H83F15N30O7 — CID 160613919

IUPAC5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide
SMILESCC1CC(C(N)=O)CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@@H]1CCCN(c2nccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@@H]1CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CCO1.NC(=O)[C@H]1CCCN(c2nccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@H]1CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CCO1
InChIInChI=1S/C19H19F3N6O.2C18H17F3N6O.2C17H15F3N6O2/c1-11-6-12(17(23)29)9-27(8-11)16-4-5-24-18(26-16)14-7-25-15-3-2-13(10-28(14)15)19(20,21)22;2*19-18(20,21)12-3-4-15-24-8-14(27(15)10-12)13-5-6-23-17(25-13)26-7-1-2-11(9-26)16(22)28;2*18-17(19,20)10-1-2-13-23-7-11(26(13)8-10)16-22-4-3-14(24-16)25-5-6-28-12(9-25)15(21)27/h2-5,7,10-12H,6,8-9H2,1H3,(H2,23,29);2*3-6,8,10-11H,1-2,7,9H2,(H2,22,28);2*1-4,7-8,12H,5-6,9H2,(H2,21,27)/t;2*11-;2*12-/m.1010/s1
InChIKeyRFVKUENKFBNGRR-DVMSONJVSA-N
MW1969.82 g/mol
LogP10.78
Rot. Bonds15

About 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide

5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide (PubChem CID 160613919) has the molecular formula C89H83F15N30O7 and a molecular weight of 1969.82 g/mol. Its IUPAC name is 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide
PubChem CID160613919
Molecular FormulaC89H83F15N30O7
Molecular Weight1969.82 g/mol
Exact Mass1968.68
IUPAC Name5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide
SMILESCC1CC(C(N)=O)CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@@H]1CCCN(c2nccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@@H]1CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CCO1.NC(=O)[C@H]1CCCN(c2nccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@H]1CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CCO1
InChIInChI=1S/C19H19F3N6O.2C18H17F3N6O.2C17H15F3N6O2/c1-11-6-12(17(23)29)9-27(8-11)16-4-5-24-18(26-16)14-7-25-15-3-2-13(10-28(14)15)19(20,21)22;2*19-18(20,21)12-3-4-15-24-8-14(27(15)10-12)13-5-6-23-17(25-13)26-7-1-2-11(9-26)16(22)28;2*18-17(19,20)10-1-2-13-23-7-11(26(13)8-10)16-22-4-3-14(24-16)25-5-6-28-12(9-25)15(21)27/h2-5,7,10-12H,6,8-9H2,1H3,(H2,23,29);2*3-6,8,10-11H,1-2,7,9H2,(H2,22,28);2*1-4,7-8,12H,5-6,9H2,(H2,21,27)/t;2*11-;2*12-/m.1010/s1
InChIKeyRFVKUENKFBNGRR-DVMSONJVSA-N
XLogP10.78
TPSA465.51 Ų
H-Bond Donors5
H-Bond Acceptors32
Rotatable Bonds15
Heavy Atoms141
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001969.82
LogP ≤ 510.78
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1032

Analyze 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide?
The IUPAC name of 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide (CID 160613919) is 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide.
What is the SMILES notation for 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide?
The canonical SMILES for 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide is CC1CC(C(N)=O)CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@@H]1CCCN(c2nccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@@H]1CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CCO1.NC(=O)[C@H]1CCCN(c2nccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)C1.NC(=O)[C@H]1CN(c2ccnc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CCO1.
What is the InChIKey of 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide?
The InChIKey is RFVKUENKFBNGRR-DVMSONJVSA-N. The full InChI is InChI=1S/C19H19F3N6O.2C18H17F3N6O.2C17H15F3N6O2/c1-11-6-12(17(23)29)9-27(8-11)16-4-5-24-18(26-16)14-7-25-15-3-2-13(10-28(14)15)19(20,21)22;2*19-18(20,21)12-3-4-15-24-8-14(27(15)10-12)13-5-6-23-17(25-13)26-7-1-2-11(9-26)16(22)28;2*18-17(19,20)10-1-2-13-23-7-11(26(13)8-10)16-22-4-3-14(24-16)25-5-6-28-12(9-25)15(21)27/h2-5,7,10-12H,6,8-9H2,1H3,(H2,23,29);2*3-6,8,10-11H,1-2,7,9H2,(H2,22,28);2*1-4,7-8,12H,5-6,9H2,(H2,21,27)/t;2*11-;2*12-/m.1010/s1.
What are the key properties of 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide?
5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide has a molecular weight of 1969.82 g/mol, XLogP of 10.78, 15 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;(2R)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(2S)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;(3R)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide;(3S)-1-[4-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]piperidine-3-carboxamide is sourced from PubChem (CID 160613919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).